Glycoside
GD028122
Name:
NoneFormula:
C13H14O5N3ClSmiles:
COc1ncnc2c1c(Cl)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
COc1ncnc2c1C(Cl)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -0.3 | Num_rotatable_bonds: | 3 |
| MolWt: | 315.71 | Num_heavy_atoms: | 21 |
| TPSA: | 109.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD18411
Formula: C8H5ON3Cl
Smiles:
COc1ncnc2c1C(Cl)=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 182.59 | Num_heavy_atoms: | 12 |
| TPSA: | 49.11 | NumAromaticRings: | 1 |
